SCHEMBL24840311

SCHEMBL24840311

CNCC(C#N)CCCOCC(O)COCCC(O)COC

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
USP2 O75604 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24840316 0.84 KDM4E (0.31)
SCHEMBL24840309 0.77 MAPT (0.31)
SCHEMBL25902384 0.72 USP2 (0.43) CYP1A2CYP3A4CYP2C19USP2
SCHEMBL18440452 0.70 USP2 (0.40) CYP1A2CYP3A4CYP2C19USP2
SCHEMBL24840347 0.69 KDM4E (0.48)
SCHEMBL14338742 0.68 USP2 (0.41) CYP1A2CYP3A4CYP2C19USP2
SCHEMBL24840312 0.67 KDM4E (0.30)
SCHEMBL9670977 0.67 USP2 (0.42) USP2
SCHEMBL16265087 0.66 HSD17B10 (0.58) CYP1A2CYP3A4CYP2C19USP2
SCHEMBL2891621 0.65

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023276954-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM 昭和電工株式会社 2023-01-05 WO disclosed